2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine

C14H23N3O2 — CID 80989314

IUPAC2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine
SMILESCNc1nc(C2CC2)nc(OCCOC(C)C)c1C
InChIInChI=1S/C14H23N3O2/c1-9(2)18-7-8-19-14-10(3)12(15-4)16-13(17-14)11-5-6-11/h9,11H,5-8H2,1-4H3,(H,15,16,17)
InChIKeyKCFYXKFEDMQUBW-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.51
Rot. Bonds7

About 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine

2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine (PubChem CID 80989314) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine
PubChem CID80989314
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine
SMILESCNc1nc(C2CC2)nc(OCCOC(C)C)c1C
InChIInChI=1S/C14H23N3O2/c1-9(2)18-7-8-19-14-10(3)12(15-4)16-13(17-14)11-5-6-11/h9,11H,5-8H2,1-4H3,(H,15,16,17)
InChIKeyKCFYXKFEDMQUBW-UHFFFAOYSA-N
XLogP2.51
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-cyclopropyl-N,5-dimethyl-6-propan-2-yloxypyrimidin-4-amine
CID 80988574
2-cyclopropyl-N,5-dimethyl-6-pentoxypyrimidin-4-amine
CID 80988065
2-cyclopropyl-N-ethyl-5-methyl-6-(3-methylbutoxy)pyrimidin-4-amine
CID 80989739
2-cyclopropyl-N-ethyl-5-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrimidin-4-amine
CID 106451543
N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine
CID 80860742
2-cyclopropyl-N-ethyl-5-methyl-6-propoxypyrimidin-4-amine
CID 80988977
6-[(2-chlorophenyl)methoxy]-2-cyclopropyl-N,5-dimethylpyrimidin-4-amine
CID 80989714
2-cyclopropyl-N,5-dimethyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80990031
2-cyclopropyl-4-N-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82456285
2-cyclopropyl-6-(2-cyclopropylethoxy)-N-ethyl-5-methylpyrimidin-4-amine
CID 106207562
2-cyclopropyl-4-N-(3-methoxypropyl)-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80980570
2-cyclopropyl-6-[2-(dimethylamino)ethoxy]-N-ethyl-5-methylpyrimidin-4-amine
CID 80988193

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine (CID 80989314) is 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine is CNc1nc(C2CC2)nc(OCCOC(C)C)c1C.
What is the InChIKey of 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine?
The InChIKey is KCFYXKFEDMQUBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-9(2)18-7-8-19-14-10(3)12(15-4)16-13(17-14)11-5-6-11/h9,11H,5-8H2,1-4H3,(H,15,16,17).
What are the key properties of 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine?
2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine has a molecular weight of 265.36 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine is sourced from PubChem (CID 80989314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).